Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 2/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | HRH1 | P35367 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | GFER | P55789 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | ABL1 | P00519 | 1/20 | 0.33 |
| ▸ | PANK3 | Q9H999 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.32 |
| ▸ | PTPRZ1 | P23471 | 1/20 | 0.32 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL10248786 | 0.88 | IDO1 (0.48) | TAAR1IDO1LOXL2MAOB | |
| SCHEMBL10570 | 0.88 | ALDH1A1 (0.52) | TAAR1ALDH1A1GFERCYP3A4TSHR | |
| SCHEMBL14392748 | 0.86 | CYP3A4 (0.41) | IDO1CYP3A4CYP1A2 | |
| SCHEMBL148198 | 0.86 | TAAR1 (0.42) | TAAR1HTR2AIDO1ALDH1A1 | |
| SCHEMBL4108567 | 0.86 | CA1 (0.38) | ESR1SLC6A2HTR2ASLC6A4HRH1 | |
| SCHEMBL25471464 | 0.86 | TRPA1 (0.43) | ESR1ALDH1A1TSHR | |
| SCHEMBL462327 | 0.86 | SLC6A4 (0.54) | TAAR1SLC6A2HTR2ASLC6A4HRH1 | |
| SCHEMBL21507936 | 0.86 | ESR1 (0.31) | ESR1 | |
| SCHEMBL21875041 | 0.86 | TRPV4 (0.34) | ESR1IDO1 | |
| SCHEMBL7191433 | 0.86 | PANK3 (0.32) | ESR1ALDH1A1ABL1PANK3FDPS |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6380415-B2 | REACTING 1,4-BIS(TRIFLUOROMETHYL)BENZENE WITH HALOGENATED SILANE IN PRESENCE OF METAL; DIMERIZATION; USEFUL IN PRODUCING RAW MATERIAL FOR HEAT-RESISTANT PARYLENE POLYMER FILMS | CENTRAL GLASS COMPANY, LIMITED (JP) | 2002-04-30 | — | — | US | disclosed |